2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol

C19H23NO2 — CID 23569814

IUPAC2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol
SMILESC=Cc1ccc(-c2ccc(CN(CCO)CCO)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-2-16-3-7-18(8-4-16)19-9-5-17(6-10-19)15-20(11-13-21)12-14-22/h2-10,21-22H,1,11-15H2
InChIKeyQVPXITDVUSJQFC-UHFFFAOYSA-N
MW297.40 g/mol
LogP2.78
Rot. Bonds8

About 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol

2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol (PubChem CID 23569814) has the molecular formula C19H23NO2 and a molecular weight of 297.40 g/mol. Its IUPAC name is 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol.

Molecular Properties

Compound Name2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol
PubChem CID23569814
Molecular FormulaC19H23NO2
Molecular Weight297.40 g/mol
Exact Mass297.17
IUPAC Name2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol
SMILESC=Cc1ccc(-c2ccc(CN(CCO)CCO)cc2)cc1
InChIInChI=1S/C19H23NO2/c1-2-16-3-7-18(8-4-16)19-9-5-17(6-10-19)15-20(11-13-21)12-14-22/h2-10,21-22H,1,11-15H2
InChIKeyQVPXITDVUSJQFC-UHFFFAOYSA-N
XLogP2.78
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-dodecyl-N-[(4-ethenylphenyl)methyl]dodecan-1-amine
CID 14420666
N-[(4-ethenylphenyl)methyl]-N-nonylnonan-1-amine
CID 14420661
N-[(4-ethenylphenyl)methyl]-N-(2-hydroxyethyl)acetamide;methane
CID 159473718
2-[(4-bromophenyl)methyl-(2-hydroxyethyl)amino]ethanol
CID 784350
2-[4-ethenyl-N-(2-hydroxyethyl)anilino]ethanol
CID 69382190
2-[[4-(difluoromethoxy)phenyl]methyl-prop-2-enylamino]ethanol
CID 111423289
2-[(4-propan-2-ylphenyl)methyl-prop-2-enylamino]ethanol
CID 115631692
3-[(4-ethenylphenyl)methyl-[(2E,3Z)-2-prop-2-ynylidenehepta-3,6-dienyl]amino]propan-1-ol
CID 142409184
[4-[[bis(prop-2-enyl)amino]methyl]phenyl]methanol
CID 83794067
2-[4-[[bis(2-hydroxyethyl)amino]methyl]phenyl]acetamide
CID 144663757
[4-[4-[N-[(4-ethenylphenyl)methyl]-4-prop-2-enoyloxyanilino]phenyl]phenyl] prop-2-enoate
CID 22089882
2-[(4-fluorophenyl)methyl-propylamino]ethanol
CID 783658

Frequently Asked Questions

What is the IUPAC name of 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol?
The IUPAC name of 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol (CID 23569814) is 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol.
What is the SMILES notation for 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol?
The canonical SMILES for 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol is C=Cc1ccc(-c2ccc(CN(CCO)CCO)cc2)cc1.
What is the InChIKey of 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol?
The InChIKey is QVPXITDVUSJQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO2/c1-2-16-3-7-18(8-4-16)19-9-5-17(6-10-19)15-20(11-13-21)12-14-22/h2-10,21-22H,1,11-15H2.
What are the key properties of 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol?
2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol has a molecular weight of 297.40 g/mol, XLogP of 2.78, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-(4-ethenylphenyl)phenyl]methyl-(2-hydroxyethyl)amino]ethanol is sourced from PubChem (CID 23569814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).